2-[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 2-[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 2-[2-(isopentylcarbamoylamino)-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 2-[[2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-[2-(3-methylbutylcarbamoylamino)-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-[[2-(isoamylcarbamoylamino)-2-keto-ethyl]thio]propionic acid Formula: C11H20N2O4S MolecularWeight: 276.3525

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)CSC(C)C(=O)O

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)CSC(C)C(=O)O

InChI

InChI=1S/C11H20N2O4S/c1-7(2)4-5-12-11(17)13-9(14)6-18-8(3)10(15)16/h7-8H,4-6H2,1-3H3,(H,15,16)(H2,12,13,14,17)